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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-96947
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 54
  • Number of elements: 4
  • Element list: ['Na', 'Ca', 'Si', 'O']
  • Chemical System: Ca-Na-O-Si
  • Density: 2.6968030113968697
  • Atomic Density: 0.07423085569702845
  • Unit Cell Volume: 727.460292528484
  • Molar Volume: 8.112719035032049
  • Full Formula: Na4 Ca6 Si12 O32
  • Reduced Formula: Na2Ca3(Si3O8)2
  • Formula Anonymous: A2B3C6D16
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1